methyl 2-[[2-(dimethylcarbamoyl)pyrrolidin-1-yl]methyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[[2-(dimethylcarbamoyl)pyrrolidin-1-yl]methyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[2-(dimethylcarbamoyl)pyrrolidin-1-yl]methyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[2-[dimethylamino(oxo)methyl]-1-pyrrolidinyl]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(dimethylcarbamoyl)pyrrolidin-1-yl]methyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[[2-(dimethylcarbamoyl)pyrrolidino]methyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CCCN1CC2=NC3=CC=CC=C3C(=C2C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CN(C)C(=O)C1CCCN1CC2=NC3=CC=CC=C3C(=C2C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O3/c1-27(2)24(29)21-14-9-15-28(21)16-20-23(25(30)31-3)22(17-10-5-4-6-11-17)18-12-7-8-13-19(18)26-20/h4-8,10-13,21H,9,14-16H2,1-3H3